5-{[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
5-{[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
5-{[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | 5752-4011 |
| Compound Name: | 5-{[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 425.28 |
| Molecular Formula: | C20 H17 Br N4 O2 |
| Smiles: | CC1/C(=C\c2ccc3c(c2)N(C)C(N3C)=O)C(N(c2ccc(cc2)[Br])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7967 |
| logD: | 3.7967 |
| logSw: | -4.0083 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.271 |
| InChI Key: | LUPOSKSDSVOTCB-UHFFFAOYSA-N |